5-(4-cyclohexylphenyl)-3-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-1,2,4-triazine

Systemtic Name: 5-(4-cyclohexylphenyl)-3-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-1,2,4-triazine Openeye Name: 5-(4-cyclohexylphenyl)-3-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-1,2,4-triazine CAS Name: 5-(4-cyclohexylphenyl)-3-[4-(4-pyridin-1-iumyl)-1-piperazinyl]-1,2,4-triazine IUPAC Name: 5-(4-cyclohexylphenyl)-3-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-1,2,4-triazine Traditional Name: 5-(4-cyclohexylphenyl)-3-(4-pyridin-1-ium-4-ylpiperazino)-1,2,4-triazine Formula: C24H29N6+ MolecularWeight: 401.52726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C3=CN=NC(=N3)N4CCN(CC4)C5=CC=[NH+]C=C5

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C3=CN=NC(=N3)N4CCN(CC4)C5=CC=[NH+]C=C5

InChI

InChI=1S/C24H28N6/c1-2-4-19(5-3-1)20-6-8-21(9-7-20)23-18-26-28-24(27-23)30-16-14-29(15-17-30)22-10-12-25-13-11-22/h6-13,18-19H,1-5,14-17H2/p+1